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Home >> Chemical Listing >> Page 881 >> 1,3-Benzothiazol-4-Ylacetic Acid

1,3-Benzothiazol-4-Ylacetic Acid
[CAS# 208117-17-3]

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Identification
Name 1,3-Benzothiazol-4-Ylacetic Acid
Synonyms 2-(benzo[d]thiazol-4-yl)acetic acid; 4-Benzothiazoleaceticacid
Molecular Structure CAS#: 208117-17-3, 1,3-Benzothiazol-4-Ylacetic Acid
Molecular Formula C9H7NO2S
Molecular Weight 193.22
CAS Registry Number 208117-17-3
SMILES OC(=O)Cc1cccc2scnc12
InChI 1S/C9H7NO2S/c11-8(12)4-6-2-1-3-7-9(6)10-5-13-7/h1-3,5H,4H2,(H,11,12)
InChIKey YAQGYEOIXUKLKH-UHFFFAOYSA-N
Properties
Density 1.445g/cm3 (Cal.)
Boiling point 387.74°C at 760 mmHg (Cal.)
Flash point 188.299°C (Cal.)
Refractive index 1.7 (Cal.)
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